1K4
Summary
| Name: | N-decanoyl-L-homoserine |
| Formula: | C14 H27 N O4 |
| Formal charge: | 0 |
| Formula weight: | 273.368 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-decanoyl-L-homoserine |
| OpenEye OEToolkits | 1.7.6 | (2S)-2-(decanoylamino)-4-oxidanyl-butanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(NC(C(=O)O)CCO)CCCCCCCCC |
| InChI | InChI | 1.03 | InChI=1S/C14H27NO4/c1-2-3-4-5-6-7-8-9-13(17)15-12(10-11-16)14(18)19/h12,16H,2-11H2,1H3,(H,15,17)(H,18,19)/t12-/m0/s1 |
| InChIKey | InChI | 1.03 | SRVJGOTYLHNRPN-LBPRGKRZSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CCCCCCCCCC(=O)N[C@@H](CCO)C(O)=O |
| SMILES | CACTVS | 3.370 | CCCCCCCCCC(=O)N[CH](CCO)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCCCCCCCCC(=O)N[C@@H](CCO)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | CCCCCCCCCC(=O)NC(CCO)C(=O)O |
